Geometry & MOs

Info

ID:	160139
PubChem CID:	57304846
Reduced:	N2O3C25H32 (1)
Stoich.:	A2B3C25D32 (1)
Weight, g/mol:	445.200156
ΔH_f, kcal/mol:	-70.68
Dipole, Da:	4.11
IP(EA), eV:	-8.88(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S)-4-amino-N-[(2S)-1-amino-1-oxo-3-(4-phenylmethoxyphenyl)propan-2-yl]-3,4-dihydro-2H-chromene-8-carboxamide

Drug info:

PubChemData

Smile

C1CCN(C1)CCOC2=CC=CC=C2C(=O)C3=CC=CC=C3OCCN4CCCC4

DOS

IR

Vibrations