Geometry & MOs

Info

ID:	146256
PubChem CID:	53659452
Reduced:	N5O5C31H39 (1)
Stoich.:	A5B5C31D39 (1)
Weight, g/mol:	165.090212
ΔH_f, kcal/mol:	-179.53
Dipole, Da:	6.39
IP(EA), eV:	-8.47(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[diamino(phenyl)methyl]formamide

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N[C@H](CC1=CC=C(C=C1)OC)C(=O)N2CCCC[C@H]2C(=O)NCC3=CC4=C(C=C3)C(=NC=C4)N

DOS

IR

Vibrations