Geometry & MOs

Info

ID:	435448
PubChem CID:	135191485
Reduced:	NO2C13H17 (1)
Stoich.:	AB2C13D17 (1)
Weight, g/mol:	124.074896
ΔH_f, kcal/mol:	-14.47
Dipole, Da:	3.36
IP(EA), eV:	-9.1(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-aminopyrrol-3-ylidene)methanediamine

Drug info:

PubChemData

Smile

CC(C)CC1=CC=C(C=C1)C(C)C(=O)N=O

DOS

IR

Vibrations