Geometry & MOs

Info

ID:	274518
PubChem CID:	103809904
Reduced:	BrON2C9H17 (1)
Stoich.:	ABC2D9E17 (1)
Weight, g/mol:	276.183778
ΔH_f, kcal/mol:	-59.59
Dipole, Da:	2.58
IP(EA), eV:	-9.46(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-N-[2-(cyclopropylmethoxy)ethyl]-4-phenylbutanamide

Drug info:

PubChemData

Smile

CC(C)(C)[C@@H](C(=O)NCC(=C)Br)N

DOS

IR

Vibrations